SCHEMBL2137908

SCHEMBL2137908

CCCCCC(SCCCCC(F)CC)C(=O)OCCCC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
EPHX1 P07099 2/20 0.36
ALDH1A1 P00352 1/20 0.35
ATM Q13315 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.33
NAAA Q02083 1/20 0.33
ACHE P22303 3/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2135858 0.97 ALDH1A1 (0.35) MAPTEPHX1ALDH1A1ATMHPGD
SCHEMBL2134639 0.97 MAPT (0.38) MAPTEPHX1ALDH1A1ATMZDHHC7
SCHEMBL2138731 0.94 MAPT (0.38) MAPTEPHX1ZDHHC7ACHECA1
SCHEMBL2136750 0.94 ALDH1A1 (0.35) MAPTEPHX1ALDH1A1ATMHPGD
SCHEMBL2137018 0.93 ALDH1A1 (0.36) MAPTEPHX1ALDH1A1ATMHPGD
SCHEMBL2134177 0.92 MAPT (0.38) MAPTEPHX1ZDHHC7CA1CA2
SCHEMBL2136706 0.92 MAPT (0.35) MAPTEPHX1ATMTSHRCA1
SCHEMBL2133478 0.90 ALDH1A1 (0.36) MAPTEPHX1ALDH1A1ATMNAAA
SCHEMBL2134575 0.90 EPHX1 (0.36) MAPTEPHX1ZDHHC7CA1CA2
SCHEMBL2138488 0.89 EPHX1 (0.34) MAPTEPHX1ALDH1A1ATMHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2664613-A1 Process for producing amide compounds Sumitomo Chemical Company, Limited (JP) 2013-11-20 EP disclosed
EP-2662355-A1 Process for producing a (fluoroalkylthio) acetonitrile Sumitomo Chemical Company, Limited (JP) 2013-11-13 EP disclosed
EP-2465846-A1 PROCESS FOR PREPARATION OF (FLUOROALKYLTHIO)ACETIC ACID ESTERS Sumitomo Chemical Company, Limited (JP) 2012-06-20 EP disclosed
US-20120101294-A1 PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120101294-A1 PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER GRHPR, AKR7A2, FAR1 MAPT 4195/4885EPHX1 2018/4885ALDH1A1 41/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.